N-[4-[[2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]amino]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[[2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]amino]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[4-methylsulfanyl-2-(p-tolylsulfonylamino)butanoyl]amino]phenyl]furan-2-carboxamide CAS Name: N-[4-[[2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)-1-oxobutyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanoyl]amino]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[4-(methylthio)-2-(tosylamino)butanoyl]amino]phenyl]-2-furamide Formula: C23H25N3O5S2 MolecularWeight: 487.5917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C23H25N3O5S2/c1-16-5-11-19(12-6-16)33(29,30)26-20(13-15-32-2)22(27)24-17-7-9-18(10-8-17)25-23(28)21-4-3-14-31-21/h3-12,14,20,26H,13,15H2,1-2H3,(H,24,27)(H,25,28)